4-(azepan-1-yl)-N-(butan-2-yl)-3-nitrobenzamide
Chemical Structure Depiction of
4-(azepan-1-yl)-N-(butan-2-yl)-3-nitrobenzamide
4-(azepan-1-yl)-N-(butan-2-yl)-3-nitrobenzamide
Compound characteristics
| Compound ID: | K781-6628 |
| Compound Name: | 4-(azepan-1-yl)-N-(butan-2-yl)-3-nitrobenzamide |
| Molecular Weight: | 319.4 |
| Molecular Formula: | C17 H25 N3 O3 |
| Smiles: | CCC(C)NC(c1ccc(c(c1)[N+]([O-])=O)N1CCCCCC1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2439 |
| logD: | 3.2439 |
| logSw: | -3.7065 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.928 |
| InChI Key: | BQNRRPUMHAQWDJ-ZDUSSCGKSA-N |